Evacetrapib

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Properties Simple | Detailed

Formula C31H37F6N6O2
IUPAC Name 4-[[(5s)-5-[[3,5-bis(trifluoromethyl)phenyl]methyl-(2-methyltetrazol-5-yl)amino]-7,9-dimethyl-2,3,4,5-tetrahydro-1-benzazepin-1-yl]methyl]cyclohexane-1-carboxylic acid
Molecular Mass 639.655 g·mol−1
Heat of Formation -1307.7 ± 16.7 kJ·mol−1
Dipole Moment 3.79 ± 1.08 D
Volume 723.3 Å 3
Surface Area 532.34 Å 2
HOMO Energy -8.29 ± 0.55 eV
LUMO Energy 1.95 ± eV
Point Group Symmetry C1
InChIKey IHIUGIVXARLYHP-YBXDKENTSA-N
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